%chk=000190085.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000190085

0 1
S 1.626098 1.225749 -1.348995
O 1.325685 -2.732032 -0.518103
O 1.300723 2.643059 -1.309799
O 2.199605 0.658425 -2.553149
N 0.154716 0.373606 -1.032083
C 0.039304 -2.038093 -0.648712
C -0.005914 -0.939820 -1.699499
C 0.190806 -3.472046 -1.072875
C -1.082324 1.188782 -0.829942
C -2.115729 0.358464 -0.079732
C -1.607772 1.792617 -2.138440
C 2.609497 0.843917 0.017928
C -2.004163 0.195757 1.319559
C -3.177741 -0.250077 -0.757781
C -4.138392 -1.008948 -0.071373
C -2.967627 -0.563291 2.000670
C -0.878427 0.805390 2.091811
C 3.116824 -0.446546 0.190390
C 2.906488 1.847386 0.948729
C -4.027133 -1.161087 1.317078
C -5.272455 -1.632979 -0.819016
C 3.920000 -0.736815 1.299710
C 3.708594 1.558852 2.054349
C 4.215094 0.264252 2.228734
H -0.421160 -1.793263 0.316802
H -0.972968 -1.007916 -2.250195
H 0.794884 -1.105024 -2.466653
H -0.167065 -4.279511 -0.438606
H 0.305710 -3.741509 -2.119668
H -0.782253 2.057000 -0.167506
H -1.746891 1.051562 -2.930484
H -0.905220 2.551615 -2.519802
H -2.566141 2.301422 -1.982366
H -3.273223 -0.133615 -1.836493
H -2.890639 -0.688899 3.079908
H 0.094239 0.425637 1.738112
H -0.859912 1.899393 1.982655
H -0.935386 0.591627 3.166229
H 2.888300 -1.242358 -0.533285
H 2.514220 2.861402 0.805766
H -4.765020 -1.742366 1.865827
H -6.037013 -0.880846 -1.064591
H -4.943856 -2.083382 -1.764945
H -5.771876 -2.423385 -0.243908
H 4.309974 -1.745215 1.434108
H 3.942911 2.338435 2.776909
H 4.842128 0.038776 3.092025


%chk=000190085-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000190085

0 1
S 1.685925 1.146925 -1.358473
O 1.263586 -2.846318 -0.596580
O 1.352917 2.749888 -1.407736
O 2.412511 0.410386 -2.624552
N 0.063730 0.153360 -0.941883
C -0.084658 -2.309808 -1.037075
C -0.061754 -1.023254 -1.843099
C 0.441956 -3.583565 -1.626644
C -1.118135 1.094538 -0.838722
C -2.177587 0.332833 -0.026617
C -1.605997 1.681655 -2.182097
C 2.724664 0.866360 0.195933
C -2.012591 0.170237 1.386111
C -3.311435 -0.226246 -0.663088
C -4.304223 -0.946056 0.048900
C -3.002743 -0.552511 2.094024
C -0.819524 0.745620 2.126012
C 3.108128 -0.444292 0.526307
C 3.089274 2.008196 0.926822
C -4.128307 -1.106708 1.443735
C -5.526335 -1.501129 -0.663155
C 3.914403 -0.607031 1.677252
C 3.900292 1.819000 2.070311
C 4.309744 0.516880 2.442104
H -0.841348 -2.365780 -0.245299
H -0.978741 -0.962463 -2.461902
H 0.802089 -1.037919 -2.540434
H 0.037147 -4.545017 -1.289086
H 0.864685 -3.570240 -2.639658
H -0.752338 1.943396 -0.230511
H -1.869130 0.909054 -2.926991
H -0.815806 2.322596 -2.607398
H -2.503271 2.304701 -2.016056
H -3.442226 -0.089559 -1.743108
H -2.887756 -0.684332 3.176681
H 0.128228 0.359197 1.709895
H -0.781164 1.849829 2.047253
H -0.860548 0.490389 3.198419
H 2.781010 -1.307128 -0.064339
H 2.753889 2.998986 0.603915
H -4.874818 -1.661565 2.025063
H -6.261465 -0.701257 -0.877661
H -5.259521 -1.964041 -1.630729
H -6.038460 -2.263749 -0.051069
H 4.227797 -1.613703 1.972495
H 4.209838 2.686214 2.663010
H 4.937567 0.377538 3.329018


